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NABUMETONE-METABOLITE

View entire compound with spectra: 1 MS (GC)

NABUMETONE-METABOLITE
SpectraBase Compound ID ClczIGM5ERk
InChI InChI=1S/C13H12O3/c14-12-5-4-10-7-9(2-6-13(15)16)1-3-11(10)8-12/h1,3-5,7-8,14H,2,6H2,(H,15,16)
InChIKey NHGXZNWPADXVOA-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C13H12O3
Exact Mass 216.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVonxFhUz1c
Name NABUMETONE-METABOLITE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12O3
InChI InChI=1S/C13H12O3/c14-12-5-4-10-7-9(2-6-13(15)16)1-3-11(10)8-12/h1,3-5,7-8,14H,2,6H2,(H,15,16)
InChIKey NHGXZNWPADXVOA-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 216.236 g/mol
SMILES OC(CCc1ccc2cc(ccc2c1)O)=O
SPLASH splash10-00di-2930000000-c84b6bf1b1e925235c92
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany